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Also known as: 204205-33-4, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone, Ethanone, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-, 2-bromo-1-cyclopropyl-2-(2-fluoro-phenyl)-ethanone, Mfcd11977644, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethan-1-one
Molecular Formula
C11H10BrFO
Molecular Weight
257.10  g/mol
InChI Key
LMCZCCDXOZGIND-UHFFFAOYSA-N

CAS 204205-33-4
1 2D Structure

CAS 204205-33-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone
2.1.2 InChI
InChI=1S/C11H10BrFO/c12-10(11(14)7-5-6-7)8-3-1-2-4-9(8)13/h1-4,7,10H,5-6H2
2.1.3 InChI Key
LMCZCCDXOZGIND-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC1C(=O)C(C2=CC=CC=C2F)Br
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 204205-33-4

2. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone

3. Ethanone, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-

4. 2-bromo-1-cyclopropyl-2-(2-fluoro-phenyl)-ethanone

5. Mfcd11977644

6. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethan-1-one

7. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-ethanone

8. Schembl242256

9. Dtxsid60634062

10. Bcp11003

11. Akos015854297

12. Sb35193

13. Ac-22646

14. As-11428

15. Cyclopropyl Carbonyl-2-fluorobenzylbromide

16. Sy067317

17. Db-027830

18. Am20090723

19. B6031

20. Ft-0649302

21. Alpha-cyclopropylcarbonyl-2-fluorobenzylbromide

22. Alpha-cyclopropylcarbonyl-2-fluorobenzyl Bromide

23. 2-bromo-2-(2-fluorophenyl)-1-cyclopropylethanon

24. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-etanon

25. 2-bromo-1-cyclopropyl-2-(2-fluorphenyl)-ethanon

26. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl) Ethanone

27. 2-bromo-2-(2-fluorophenyl)-1-cyclopropyl-ethanone

28. J-508185

29. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-?ethanone

30. Ethanone,2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-

2.3 Create Date
2007-12-06
3 Chemical and Physical Properties
Molecular Weight 257.10 g/mol
Molecular Formula C11H10BrFO
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass255.98991 g/mol
Monoisotopic Mass255.98991 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count14
Formal Charge0
Complexity227
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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